(11E,13E)-9-azanyl-9-methyl-15-oxidanyl-8-oxidanylidene-icosa-11,13-dienoic acid

Systemtic Name: (11E,13E)-9-azanyl-9-methyl-15-oxidanyl-8-oxidanylidene-icosa-11,13-dienoic acid Openeye Name: (11E,13E)-9-amino-15-hydroxy-9-methyl-8-oxo-icosa-11,13-dienoic acid CAS Name: (11E,13E)-9-amino-15-hydroxy-9-methyl-8-oxoeicosa-11,13-dienoic acid IUPAC Name: (11E,13E)-9-amino-15-hydroxy-9-methyl-8-oxoicosa-11,13-dienoic acid Traditional Name: (11E,13E)-9-amino-15-hydroxy-8-keto-9-methyl-eicosa-11,13-dienoic acid Formula: C21H37NO4 MolecularWeight: 367.52278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC=CCC(C)(C(=O)CCCCCCC(=O)O)N)O

Isomeric SMILES

CCCCCC(/C=C/C=C/CC(C)(C(=O)CCCCCCC(=O)O)N)O

InChI

InChI=1S/C21H37NO4/c1-3-4-8-13-18(23)14-9-7-12-17-21(2,22)19(24)15-10-5-6-11-16-20(25)26/h7,9,12,14,18,23H,3-6,8,10-11,13,15-17,22H2,1-2H3,(H,25,26)/b12-7+,14-9+